Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.40 |
| ▸ | GPR3 | P46089 | 2/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.34 |
| ▸ | AHR | P35869 | 3/20 | 0.34 |
| ▸ | GAA | P10253 | 3/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | ATM | Q13315 | 2/20 | 0.34 |
| ▸ | HPGD | P15428 | 2/20 | 0.34 |
| ▸ | GLA | P06280 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.32 |
| ▸ | MEN1 | O00255 | 2/20 | 0.32 |
| ▸ | PARP1 | P09874 | 2/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.32 |
| ▸ | TNKS | O95271 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | BLM | P54132 | 1/20 | 0.32 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL3849040 | 0.71 | ALDH1A1 (0.40) | ALDH1A1GPR3HSD17B10KDM4EAHR | |
| SCHEMBL9723837 | 0.71 | ALDH1A1 (0.40) | ALDH1A1GPR3HSD17B10KDM4EAHR | |
| SCHEMBL2987901 | 0.71 | ALDH1A1 (0.40) | ALDH1A1GPR3HSD17B10KDM4EAHR | |
| SCHEMBL127256 | 0.71 | ALDH1A1 (0.40) | ALDH1A1GPR3HSD17B10KDM4EAHR | |
| SCHEMBL570354 | 0.71 | ALDH1A1 (0.40) | ALDH1A1GPR3HSD17B10KDM4EAHR | |
| SCHEMBL2073631 | 0.71 | ALDH1A1 (0.40) | ALDH1A1GPR3HSD17B10KDM4EAHR | |
| SCHEMBL546371 | 0.71 | CYP1A2 (0.42) | ALDH1A1GPR3HSD17B10KDM4EAHR | |
| SCHEMBL650736 | 0.71 | KDM4E (0.41) | ALDH1A1GPR3HSD17B10KDM4EAHR | |
| SCHEMBL1639050 | 0.71 | ALDH1A1 (0.40) | ALDH1A1GPR3HSD17B10KDM4EAHR | |
| SCHEMBL16760105 | 0.71 | KIF11 (0.39) | ALDH1A1GPR3HSD17B10AHRATM |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109232363-A | A kind of synthetic method of 3- selenium cyanoindole compound | 安徽理工大学 | 2019-01-18 | — | — | CN | disclosed |